2-ethoxy-N-quinolin-8-ylbenzamide

C18H16N2O2 — CID 836546

IUPAC2-ethoxy-N-quinolin-8-ylbenzamide
SMILESCCOc1ccccc1C(=O)Nc1cccc2cccnc12
InChIInChI=1S/C18H16N2O2/c1-2-22-16-11-4-3-9-14(16)18(21)20-15-10-5-7-13-8-6-12-19-17(13)15/h3-12H,2H2,1H3,(H,20,21)
InChIKeyQAYFQKDEZOJHQO-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.89
Rot. Bonds4

About 2-ethoxy-N-quinolin-8-ylbenzamide

2-ethoxy-N-quinolin-8-ylbenzamide (PubChem CID 836546) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-ethoxy-N-quinolin-8-ylbenzamide.

Molecular Properties

Compound Name2-ethoxy-N-quinolin-8-ylbenzamide
PubChem CID836546
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name2-ethoxy-N-quinolin-8-ylbenzamide
SMILESCCOc1ccccc1C(=O)Nc1cccc2cccnc12
InChIInChI=1S/C18H16N2O2/c1-2-22-16-11-4-3-9-14(16)18(21)20-15-10-5-7-13-8-6-12-19-17(13)15/h3-12H,2H2,1H3,(H,20,21)
InChIKeyQAYFQKDEZOJHQO-UHFFFAOYSA-N
XLogP3.89
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-quinolin-8-ylbenzamide?
The IUPAC name of 2-ethoxy-N-quinolin-8-ylbenzamide (CID 836546) is 2-ethoxy-N-quinolin-8-ylbenzamide.
What is the SMILES notation for 2-ethoxy-N-quinolin-8-ylbenzamide?
The canonical SMILES for 2-ethoxy-N-quinolin-8-ylbenzamide is CCOc1ccccc1C(=O)Nc1cccc2cccnc12.
What is the InChIKey of 2-ethoxy-N-quinolin-8-ylbenzamide?
The InChIKey is QAYFQKDEZOJHQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-2-22-16-11-4-3-9-14(16)18(21)20-15-10-5-7-13-8-6-12-19-17(13)15/h3-12H,2H2,1H3,(H,20,21).
What are the key properties of 2-ethoxy-N-quinolin-8-ylbenzamide?
2-ethoxy-N-quinolin-8-ylbenzamide has a molecular weight of 292.34 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-quinolin-8-ylbenzamide is sourced from PubChem (CID 836546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).